[1-[3-(2-methylphenyl)phenyl]piperidin-4-yl]-[(3S)-thiolan-3-yl]azanium

Systemtic Name: [1-[3-(2-methylphenyl)phenyl]piperidin-4-yl]-[(3S)-thiolan-3-yl]azanium Openeye Name: [1-[3-(o-tolyl)phenyl]-4-piperidyl]-[(3S)-tetrahydrothiophen-3-yl]ammonium CAS Name: [1-[3-(2-methylphenyl)phenyl]-4-piperidinyl]-[(3S)-3-thiolanyl]ammonium IUPAC Name: [1-[3-(2-methylphenyl)phenyl]piperidin-4-yl]-[(3S)-thiolan-3-yl]azanium Traditional Name: [1-[3-(o-tolyl)phenyl]-4-piperidyl]-[(3S)-tetrahydrothiophen-3-yl]ammonium Formula: C22H29N2S+ MolecularWeight: 353.54406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=CC=C2)N3CCC(CC3)[NH2+]C4CCSC4

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=CC=C2)N3CCC(CC3)[NH2+][C@H]4CCSC4

InChI

InChI=1S/C22H28N2S/c1-17-5-2-3-8-22(17)18-6-4-7-21(15-18)24-12-9-19(10-13-24)23-20-11-14-25-16-20/h2-8,15,19-20,23H,9-14,16H2,1H3/p+1/t20-/m0/s1